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160543-16-8 | Benz[c]acridine-5,6-diol, 5,6-dihydro-7,9-dimethyl-, trans- (9CI)
CAS No: 160543-16-8 Catalog No: AG001S0L MDL No:
Product Description
Catalog Number:
AG001S0L
Chemical Name:
Benz[c]acridine-5,6-diol, 5,6-dihydro-7,9-dimethyl-, trans- (9CI)
CAS Number:
160543-16-8
Molecular Formula:
C19H17NO2
Molecular Weight:
291.3438
IUPAC Name:
(5R,6R)-7,9-dimethyl-5,6-dihydrobenzo[c]acridine-5,6-diol
InChI:
InChI=1S/C19H17NO2/c1-10-7-8-15-14(9-10)11(2)16-17(20-15)12-5-3-4-6-13(12)18(21)19(16)22/h3-9,18-19,21-22H,1-2H3/t18-,19-/m1/s1
InChI Key:
DEHCWDNRUHPPAK-RTBURBONSA-N
SMILES:
Cc1ccc2c(c1)c(C)c1c(n2)c2ccccc2[C@H]([C@@H]1O)O
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
291.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.35g/mol
Monoisotopic Mass:
291.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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